In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 13 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.41 | -0.58 | -34.01 | 4 | 4 | 1 | 64 | 186.279 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.41 | 1.14 | -100.32 | 5 | 4 | 2 | 65 | 187.287 | 4 | ↓ |